SCHEMBL11525136

SCHEMBL11525136

CC(C)(C)OC(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 10/20 0.64
CTSK P43235 9/20 0.64
ACE P12821 1/20 0.61
CTSB P07858 4/20 0.61
CTSL P07711 1/20 0.61
OPRD1 P41143 5/20 0.54
OPRM1 P35372 4/20 0.54
AKT1 P31749 1/20 0.54
OPRK1 P41145 1/20 0.54
PSMB1 P20618 1/20 0.54
PSMB8 P28062 1/20 0.54
PSMB9 P28065 1/20 0.54
PSMB5 P28074 1/20 0.54
PSMB10 P40306 1/20 0.54
PSMB2 P49721 1/20 0.54
PPARA Q07869 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11523721 1.00 CTSS (0.64) CTSSCTSKACECTSBCTSL
SCHEMBL11525133 1.00 CTSS (0.64) CTSSCTSKACECTSBCTSL
SCHEMBL8580174 0.92 REN (0.60) CTSSCTSKACECTSBCTSL
SCHEMBL11528388 0.91 CTSS (0.61) CTSSCTSKACECTSBCTSL
SCHEMBL30865868 0.91 CTSS (0.61) CTSSCTSKACECTSBCTSL
SCHEMBL30100564 0.91 CTSS (0.61) CTSSCTSKACECTSBCTSL
SCHEMBL236543 0.91 OPRD1 (0.64) CTSSCTSKACECTSBCTSL
SCHEMBL236544 0.91 OPRD1 (0.64) CTSSCTSKACECTSBCTSL
SCHEMBL11607639 0.89 CTSS (0.63) CTSSCTSKACECTSBCTSL
SCHEMBL30100566 0.89 CTSS (0.63) CTSSCTSKACECTSBCTSL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170290892-A1 POLYMERIC ENKEPHALIN PRODRUGS PEG BIOSCIENCES, INC. (US) 2017-10-12 US disclosed
EP-3169406-A1 POLYMERIC ENKEPHALIN PRODRUGS PEG Biosciences, Inc. (US) 2017-05-24 EP disclosed
CN-106535944-A Polymeric enkephalin prodrugs PEG生物制药公司 2017-03-22 CN disclosed
WO-2016011037-A1 POLYMERIC ENKEPHALIN PRODRUGS PEG BIOSCIENCES, INC. (US) 2016-01-21 WO disclosed
US-4144228-A Methionine5 -enkephalin sulfoxides and sulfones G. D. SEARLE & CO. (US) 1979-03-13 US disclosed